LAMMPS (19 Mar 2020)
OMP_NUM_THREADS environment is not set. Defaulting to 1 thread. (../comm.cpp:94)
  using 1 OpenMP thread(s) per MPI task
# start a spin-lattice simulation from a data file
units 		metal
atom_style 	spin

dimension 	3
boundary 	p p p

# necessary for the serial algorithm (sametag)
atom_modify 	map array

read_restart	restart_hcp_cobalt.equil
  restoring atom style spin from restart
  orthogonal box = (0 0 0) to (12.5355 21.7121 20.4704)
  1 by 2 by 2 MPI processor grid
  restoring pair style spin/exchange from restart
  500 atoms
  read_restart CPU = 0.00173593 secs

# setting mass, mag. moments, and interactions

mass		1 58.93

pair_style 	hybrid/overlay eam/alloy spin/exchange 4.0
pair_coeff 	* * eam/alloy Co_PurjaPun_2012.eam.alloy Co
pair_coeff 	* * spin/exchange exchange 4.0 0.3593 1.135028015e-05 1.064568567

neighbor 	1.0 bin
neigh_modify 	every 1 check no delay 0

fix 		1 all precession/spin zeeman 0.0 0.0 0.0 1.0
fix 		2 all langevin/spin 0.0 0.0 21

fix 		3 all nve/spin lattice moving
timestep	0.0001

# define outputs

compute 	out_mag    all spin
compute 	out_pe     all pe
compute 	out_ke     all ke
compute 	out_temp   all temp

variable 	magz      equal c_out_mag[3]
variable 	magnorm   equal c_out_mag[4]
variable 	emag      equal c_out_mag[5]
variable 	tmag      equal c_out_mag[6]

thermo          20
thermo_style    custom step time v_magnorm pe v_emag v_tmag temp etotal
thermo_modify   format float %20.15g

compute 	outsp all property/atom spx spy spz sp fmx fmy fmz
dump 		100 all custom 1 dump.lammpstrj type x y z c_outsp[1] c_outsp[2] c_outsp[3] c_outsp[4] c_outsp[5] c_outsp[6] c_outsp[7]

run 		100
Neighbor list info ...
  update every 1 steps, delay 0 steps, check no
  max neighbors/atom: 2000, page size: 100000
  master list distance cutoff = 7.49954
  ghost atom cutoff = 7.49954
  binsize = 3.74977, bins = 4 6 6
  2 neighbor lists, perpetual/occasional/extra = 2 0 0
  (1) pair eam/alloy, perpetual, half/full from (2)
      attributes: half, newton on
      pair build: halffull/newton
      stencil: none
      bin: none
  (2) pair spin/exchange, perpetual
      attributes: full, newton on
      pair build: full/bin/atomonly
      stencil: full/bin/3d
      bin: standard
Per MPI rank memory allocation (min/avg/max) = 7.324 | 7.324 | 7.324 Mbytes
Step Time v_magnorm PotEng v_emag v_tmag Temp TotEng 
    1000                    0    0.108317262557656    -2200.38241212182    -5.38245988668244      2538.4247868621                    0    -2200.38241212182 
    1020                0.002    0.108317316216432    -2200.39172132147    -5.39179331147409     2513.42945241007     0.14431996581917    -2200.38241256644 
    1040                0.004    0.108317347939802    -2200.41811580574    -5.41854152831072     2478.87544274124    0.553516446104432    -2200.38241354532 
    1060                0.006    0.108317342440309    -2200.45801216927    -5.45990063373049     2449.77218633122     1.17203801398165    -2200.38241476526 
    1080                0.008    0.108317320345284    -2200.50688241767    -5.51245984623572      2427.2497145488     1.92968619968329     -2200.3824160902 
    1100                 0.01     0.10831728372281    -2200.55976028296    -5.57250070536486     2400.86059511731     2.74946919265255    -2200.38241728649 
Loop time of 0.405615 on 4 procs for 100 steps with 500 atoms

Performance: 2.130 ns/day, 11.267 hours/ns, 246.539 timesteps/s
99.7% CPU use with 4 MPI tasks x 1 OpenMP threads

MPI task timing breakdown:
Section |  min time  |  avg time  |  max time  |%varavg| %total
---------------------------------------------------------------
Pair    | 0.075661   | 0.076798   | 0.077343   |   0.2 | 18.93
Neigh   | 0.063154   | 0.064974   | 0.066991   |   0.5 | 16.02
Comm    | 0.012538   | 0.013787   | 0.015151   |   0.8 |  3.40
Output  | 0.039155   | 0.040842   | 0.042502   |   0.6 | 10.07
Modify  | 0.20709    | 0.20883    | 0.21036    |   0.3 | 51.49
Other   |            | 0.0003826  |            |       |  0.09

Nlocal:    125 ave 127 max 122 min
Histogram: 1 0 0 0 1 0 0 0 0 2
Nghost:    1387 ave 1390 max 1385 min
Histogram: 2 0 0 0 0 0 1 0 0 1
Neighs:    9125 ave 9272 max 8945 min
Histogram: 1 0 0 1 0 0 0 0 1 1
FullNghs:  18250 ave 18542 max 17812 min
Histogram: 1 0 0 0 1 0 0 0 0 2

Total # of neighbors = 73000
Ave neighs/atom = 146
Neighbor list builds = 100
Dangerous builds not checked

Please see the log.cite file for references relevant to this simulation

Total wall time: 0:00:00
